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AC-ALA-GLY-OMEGA-(PO2ET-N)-PRO-PHE-OMEGA-(CH2-NH)-PNA
SpectraBase Compound ID HnrhnDcpqVj
InChI InChI=1S/C28H39N6O7P/c1-4-41-42(40,19-30-27(36)20(2)31-21(3)35)33-16-8-11-26(33)28(37)32-24(17-22-9-6-5-7-10-22)18-29-23-12-14-25(15-13-23)34(38)39/h5-7,9-10,12-15,20,24,26,29H,4,8,11,16-19H2,1-3H3,(H,30,36)(H,31,35)(H,32,37)/t20-,24-,26-,42?/m0/s1
InChIKey FKDSRUFKQBOLMI-KECTXOEJSA-N
Mol Weight 602.6 g/mol
Molecular Formula C28H39N6O7P
Exact Mass 602.261785 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 13NBUDchS9b
Name AC-ALA-GLY-OMEGA-(PO2ET-N)-PRO-PHE-OMEGA-(CH2-NH)-PNA
Compound Number 7B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H39N6O7P
InChI InChI=1S/C28H39N6O7P/c1-4-41-42(40,19-30-27(36)20(2)31-21(3)35)33-16-8-11-26(33)28(37)32-24(17-22-9-6-5-7-10-22)18-29-23-12-14-25(15-13-23)34(38)39/h5-7,9-10,12-15,20,24,26,29H,4,8,11,16-19H2,1-3H3,(H,30,36)(H,31,35)(H,32,37)/t20-,24-,26-,42?/m0/s1
InChIKey FKDSRUFKQBOLMI-KECTXOEJSA-N
Literature Reference Author L.DEMANGE,M.MOUTIEZ,C.DUGAVE
Literature Reference Citation J.MED.CHEM.,45,3928(2002)
Literature Reference DOI 10.1021/jm020865i
Solvent CDCl3
Source File Reference UWLU64809